2-[2-(3-bromophenyl)pyrrolidin-1-yl]-N-(cyclopentylcarbamoyl)acetamide

C18H24BrN3O2 — CID 55839341

IUPAC2-[2-(3-bromophenyl)pyrrolidin-1-yl]-N-(cyclopentylcarbamoyl)acetamide
SMILESO=C(CN1CCCC1c1cccc(Br)c1)NC(=O)NC1CCCC1
InChIInChI=1S/C18H24BrN3O2/c19-14-6-3-5-13(11-14)16-9-4-10-22(16)12-17(23)21-18(24)20-15-7-1-2-8-15/h3,5-6,11,15-16H,1-2,4,7-10,12H2,(H2,20,21,23,24)
InChIKeyNOQBEVPCQANTIM-UHFFFAOYSA-N
MW394.31 g/mol
LogP3.35
Rot. Bonds4

About 2-[2-(3-bromophenyl)pyrrolidin-1-yl]-N-(cyclopentylcarbamoyl)acetamide

2-[2-(3-bromophenyl)pyrrolidin-1-yl]-N-(cyclopentylcarbamoyl)acetamide (PubChem CID 55839341) has the molecular formula C18H24BrN3O2 and a molecular weight of 394.31 g/mol. Its IUPAC name is 2-[2-(3-bromophenyl)pyrrolidin-1-yl]-N-(cyclopentylcarbamoyl)acetamide.

Molecular Properties

Compound Name2-[2-(3-bromophenyl)pyrrolidin-1-yl]-N-(cyclopentylcarbamoyl)acetamide
PubChem CID55839341
Molecular FormulaC18H24BrN3O2
Molecular Weight394.31 g/mol
Exact Mass393.11
IUPAC Name2-[2-(3-bromophenyl)pyrrolidin-1-yl]-N-(cyclopentylcarbamoyl)acetamide
SMILESO=C(CN1CCCC1c1cccc(Br)c1)NC(=O)NC1CCCC1
InChIInChI=1S/C18H24BrN3O2/c19-14-6-3-5-13(11-14)16-9-4-10-22(16)12-17(23)21-18(24)20-15-7-1-2-8-15/h3,5-6,11,15-16H,1-2,4,7-10,12H2,(H2,20,21,23,24)
InChIKeyNOQBEVPCQANTIM-UHFFFAOYSA-N
XLogP3.35
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.31
LogP ≤ 53.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[2-(3-bromophenyl)pyrrolidin-1-yl]-N-(cyclopentylcarbamoyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(cyclohexylcarbamoyl)-2-[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]acetamide
CID 9444099
N-(cyclopropylcarbamoyl)-2-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]acetamide
CID 46802404
N-(cyclohexylcarbamoyl)-2-[(2S)-2-thiophen-2-ylpyrrolidin-1-yl]acetamide
CID 9208528
N-(cyclopentylcarbamoyl)-2-[2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]acetamide
CID 46671211
N-(ethylcarbamoyl)-2-[(2S)-2-(3-methoxyphenyl)pyrrolidin-1-yl]acetamide
CID 41415749
2-(2-cyclopentylpyrrolidin-1-yl)-N-(cyclopropylcarbamoyl)acetamide
CID 47314665
N-cyclohexyl-3-[2-(3-methoxyphenyl)pyrrolidin-1-yl]propanamide
CID 51313431
2-[2-(3-methoxyphenyl)pyrrolidin-1-yl]-N-(phenylcarbamoyl)acetamide
CID 24596121
1-[2-(cyclopentylcarbamoylamino)-2-oxoethyl]-N-cyclopropylpyrrolidine-2-carboxamide
CID 42884475
2-(2-phenylpyrrolidin-1-yl)-N-(propylcarbamoyl)acetamide
CID 18137773
4-[[2-(3-bromophenyl)pyrrolidine-1-carbonyl]amino]cyclohexane-1-carboxylic acid
CID 122025053
2-(3-bromophenyl)-N-cyclopentylacetamide
CID 62605138

Frequently Asked Questions

What is the IUPAC name of 2-[2-(3-bromophenyl)pyrrolidin-1-yl]-N-(cyclopentylcarbamoyl)acetamide?
The IUPAC name of 2-[2-(3-bromophenyl)pyrrolidin-1-yl]-N-(cyclopentylcarbamoyl)acetamide (CID 55839341) is 2-[2-(3-bromophenyl)pyrrolidin-1-yl]-N-(cyclopentylcarbamoyl)acetamide.
What is the SMILES notation for 2-[2-(3-bromophenyl)pyrrolidin-1-yl]-N-(cyclopentylcarbamoyl)acetamide?
The canonical SMILES for 2-[2-(3-bromophenyl)pyrrolidin-1-yl]-N-(cyclopentylcarbamoyl)acetamide is O=C(CN1CCCC1c1cccc(Br)c1)NC(=O)NC1CCCC1.
What is the InChIKey of 2-[2-(3-bromophenyl)pyrrolidin-1-yl]-N-(cyclopentylcarbamoyl)acetamide?
The InChIKey is NOQBEVPCQANTIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24BrN3O2/c19-14-6-3-5-13(11-14)16-9-4-10-22(16)12-17(23)21-18(24)20-15-7-1-2-8-15/h3,5-6,11,15-16H,1-2,4,7-10,12H2,(H2,20,21,23,24).
What are the key properties of 2-[2-(3-bromophenyl)pyrrolidin-1-yl]-N-(cyclopentylcarbamoyl)acetamide?
2-[2-(3-bromophenyl)pyrrolidin-1-yl]-N-(cyclopentylcarbamoyl)acetamide has a molecular weight of 394.31 g/mol, XLogP of 3.35, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(3-bromophenyl)pyrrolidin-1-yl]-N-(cyclopentylcarbamoyl)acetamide is sourced from PubChem (CID 55839341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).